V020-0641 Screening compound: prop-2-en-1-yl 3-{[benzyl(methyl)carbamoyl]methyl}-5-(3,4-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

V020-0641 Screening compound: prop-2-en-1-yl 3-{[benzyl(methyl)carbamoyl]methyl}-5-(3,4-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
V020-0641 Screening compound: prop-2-en-1-yl 3-{[benzyl(methyl)carbamoyl]methyl}-5-(3,4-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-0641
prop-2-en-1-yl 3-{[benzyl(methyl)carbamoyl]methyl}-5-(3,4-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

V020-0641

Molecular Formula

C29H31N3O5S (C29 H31 N3 O5 S)

Compound Name

prop-2-en-1-yl 3-{[benzyl(methyl)carbamoyl]methyl}-5-(3,4-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

IUPAC name

prop-2-en-1-yl 3-{[benzyl(methyl)carbamoyl]methyl}-5-(34-dimethoxyphenyl)-7-methyl-5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CC(N=C1SC=C(CC(N(C)Cc2ccccc2)=O)N1C1c(cc2)cc(OC)c2OC)=C1C(OCC=C)=O

InChI

InChI=1S/C29H31N3O5S/c1-6-14-37-28(34)26-19(2)30-29-32(27(26)21-12-13-23(35-4)24(15-21)36-5)22(18-38-29)16-25(33)31(3)17-20-10-8-7-9-11-20/h6-13,15,18,27H,1,14,16-17H2,2-5H3/t27-/m1/s1

InChI Key

ONJYLSORVRLCDB-HHHXNRCGSA-N

MDL Number (MFCD)

MFCD19828446

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

533.65

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.299

Distribution Coefficient, logD

4.299

Water Solubility, LogSw

-4.49

Polar Surface Area

63.588

Acid Dissociation Constant (pKa)

19.05

Base Dissociation Constant (pKb)

3.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.60

References: we are preparing a list of scientific research reports with V020-0641 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-0641?
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What is the minimum amount of V020-0641 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-0641
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-0641
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of V020-0641 available by request